SCHEMBL7730108

SCHEMBL7730108

CCOC(=O)Nc1cc(-c2ccc(OC)c(F)c2)nn(CC=Cc2ccc(Cl)cc2)c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 1/20 0.41
TSHR P16473 3/20 0.40
ALDH1A1 P00352 3/20 0.40
MAPK1 P28482 1/20 0.40
LMNA P02545 3/20 0.39
POLB P06746 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
PDE4B Q07343 4/20 0.39
VCP P55072 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
HTT P42858 1/20 0.36
MET P08581 1/20 0.36
KDM4E B2RXH2 2/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MAPT P10636 3/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7730105 1.00 P2RX3 (0.41) P2RX3TSHRALDH1A1MAPK1LMNA
SCHEMBL7723587 0.93 ALDH1A1 (0.43) TSHRALDH1A1MAPK1LMNAPOLB
SCHEMBL7723586 0.93 ALDH1A1 (0.43) TSHRALDH1A1MAPK1LMNAPOLB
SCHEMBL7720201 0.92 TSHR (0.41) P2RX3TSHRALDH1A1MAPK1LMNA
SCHEMBL7720205 0.92 TSHR (0.41) P2RX3TSHRALDH1A1MAPK1LMNA
SCHEMBL7723481 0.88 KMT2A (0.47) TSHRALDH1A1MAPK1LMNAPOLB
SCHEMBL7723477 0.88 KMT2A (0.47) TSHRALDH1A1MAPK1LMNAPOLB
SCHEMBL1925170 0.84 ALDH1A1 (0.39) P2RX3TSHRALDH1A1MAPK1NPC1
SCHEMBL1925169 0.84 ALDH1A1 (0.39) P2RX3TSHRALDH1A1MAPK1NPC1
SCHEMBL7730137 0.83 TSHR (0.45) TSHRALDH1A1MAPK1LMNAPOLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6403586-B1 Pyridazine derivatives and drugs containing the same as the active ingredient KOWA CO., LTD. (JP) 2002-06-11 US disclosed
EP-1061077-A1 NOVEL PYRIDAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT Kowa Co., Ltd. (JP) 2000-12-20 EP disclosed